Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 9/20 | 0.53 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2056993 | 0.82 | HPGD (0.56) | TP53GAAMAPT | |
| SCHEMBL6751301 | 0.77 | MRGPRX4 (0.55) | MAOBAPPNPC1RAB9ASMPD1 | |
| SCHEMBL6850661 | 0.74 | MAOB (0.49) | MAOBAPPNPC1RAB9ATDP1 | |
| SCHEMBL791922 | 0.72 | MAOB (0.72) | MAOBAPPNPC1RAB9ATDP1 | |
| SCHEMBL11955055 | 0.72 | CYP2A6 (0.46) | TP53MAPT | |
| SCHEMBL6751659 | 0.71 | SMPD1 (0.51) | MAOBAPPNPC1RAB9ASMPD1 | |
| SCHEMBL4029474 | 0.71 | NPC1 (0.57) | MAOBAPPNPC1RAB9ATDP1 | |
| SCHEMBL791569 | 0.70 | MAOB (1.00) | MAOBAPPMRGPRX4 | |
| SCHEMBL18429793 | 0.70 | APP (1.00) | MAOBAPPNPC1RAB9ATDP1 | |
| SCHEMBL6751316 | 0.70 | ERBB2 (0.37) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004058265-A1 | COMPOUND LIBRARIES OF 2,3-SUBSTITUTED PYRAZINE DERIVATIVES CAPABLE OF BINDING TO G-PROTEIN COUPLED RECEPTORS | BIOFOCUS PLC (GB) | 2004-07-15 | — | — | WO | disclosed |